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1,1'-[METHYLENEBIS-(BENZENE-1,4-DIYLMETHYLENE)]-BIS-[(4-HYDROXYMETHYL)-PYRIDINIUM]-DIBROMIDE
SpectraBase Compound ID Av9GDuMM7Lp
InChI InChI=1S/C27H28N2O2.2BrH/c30-20-26-9-13-28(14-10-26)18-24-5-1-22(2-6-24)17-23-3-7-25(8-4-23)19-29-15-11-27(21-31)12-16-29;;/h1-16,30-31H,17-21H2;2*1H/q+2;;/p-2
InChIKey WTZOFJZAGMWSAT-UHFFFAOYSA-L
Mol Weight 572.341 g/mol
Molecular Formula C27H28Br2N2O2
Exact Mass 570.051754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3GR4QTHdoQM
Name 1,1'-[METHYLENEBIS-(BENZENE-1,4-DIYLMETHYLENE)]-BIS-[(4-HYDROXYMETHYL)-PYRIDINIUM]-DIBROMIDE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H28Br2N2O2
InChI InChI=1S/C27H28N2O2.2BrH/c30-20-26-9-13-28(14-10-26)18-24-5-1-22(2-6-24)17-23-3-7-25(8-4-23)19-29-15-11-27(21-31)12-16-29;;/h1-16,30-31H,17-21H2;2*1H/q+2;;/p-2
InChIKey WTZOFJZAGMWSAT-UHFFFAOYSA-L
Literature Reference Author J.M.CAMPOS,M.C.NUNEZ,R.M.SANCHEZ,J.A.GOMEZ-VIDAL,A.RODRIGUEZ -GONZALEZ,M.BANEZ,M.
Literature Reference Citation BIOORG.MED.CHEM.,10,2215(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00054-8
Molecular Weight 572.340 g/mol
Solvent CD3OD
Source File Reference UWVN28462